| SpectraBase Compound ID | ARZEEEDumZf |
|---|---|
| InChI | InChI=1S/C60H102N6O10S3/c1-11-13-14-15-16-17-18-19-20-21-22-23-24-33-54(68)79-43-50(65-60(74)76-37-12-2)56(70)63-48(35-38-77-10)55(69)61-41-53(67)62-49(40-45(5)6)58(72)66-36-27-32-52(66)57(71)64-51(59(73)75-9)42-78-39-34-47(8)31-26-30-46(7)29-25-28-44(3)4/h12,28,30,34,45,48-52H,2,11,13-27,29,31-33,35-43H2,1,3-10H3,(H,61,69)(H,62,67)(H,63,70)(H,64,71)(H,65,74)/b46-30+,47-34+/t48-,49-,50-,51+,52-/m0/s1 |
| InChIKey | KAWCPBPEPHEUQT-KHHDJEKMSA-N |
| Mol Weight | 1163.7 g/mol |
| Molecular Formula | C60H102N6O10S3 |
| Exact Mass | 1162.681957 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 227klsTbGSa |
|---|---|
| Name | N-ALLYLOXYCARBONYL-(S-PALMITOYL)-L-CYSTEYL-L-METHIONYL-GLYCYL-L-LEUCYL-L-PROLYL-(S-FARNESYL)-L-CYSTEINE-METHYLESTER;ALOCCYS(PAL)-METGLYLEUPROCYS-(F |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H102N6O10S3 |
| InChI | InChI=1S/C60H102N6O10S3/c1-11-13-14-15-16-17-18-19-20-21-22-23-24-33-54(68)79-43-50(65-60(74)76-37-12-2)56(70)63-48(35-38-77-10)55(69)61-41-53(67)62-49(40-45(5)6)58(72)66-36-27-32-52(66)57(71)64-51(59(73)75-9)42-78-39-34-47(8)31-26-30-46(7)29-25-28-44(3)4/h12,28,30,34,45,48-52H,2,11,13-27,29,31-33,35-43H2,1,3-10H3,(H,61,69)(H,62,67)(H,63,70)(H,64,71)(H,65,74)/b46-30+,47-34+/t48-,49-,50-,51+,52-/m0/s1 |
| InChIKey | KAWCPBPEPHEUQT-KHHDJEKMSA-N |
| Literature Reference Author | M.SCHELHAAS,E.NAEGELE,N.KUDER,B.BADER,J.KUHLMANN,A.WITTINGHO FER,H.WALDMANN |
| Literature Reference Citation | CHEM.EUR.J.,5,1239(1999) |
| Literature Reference DOI | 10.1002/(sici)1521-3765(19990401)5:4<1239::aid-chem1239>3.3.co;2-e |
| Molecular Weight | 1163.684 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU9623 |